CID 134889513

C8H8CoNaO5 — CID 134889513

IUPAC—
SMILESC1CCOC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Na]
InChIInChI=1S/C4H8O.4CO.Co.Na/c1-2-4-5-3-1;4*1-2;;/h1-4H2;;;;;;
InChIKeyRCQFFISIVJGACJ-UHFFFAOYSA-N
MW266.07 g/mol
LogP0.26
Rot. Bonds

About CID 134889513

CID 134889513 (PubChem CID 134889513) has the molecular formula C8H8CoNaO5 and a molecular weight of 266.07 g/mol.

Molecular Properties

Compound NameCID 134889513
PubChem CID134889513
Molecular FormulaC8H8CoNaO5
Molecular Weight266.07 g/mol
Exact Mass265.96
IUPAC Name—
SMILESC1CCOC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Na]
InChIInChI=1S/C4H8O.4CO.Co.Na/c1-2-4-5-3-1;4*1-2;;/h1-4H2;;;;;;
InChIKeyRCQFFISIVJGACJ-UHFFFAOYSA-N
XLogP0.26
TPSA88.83 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.07
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Related Compounds

bromorhenium;carbon monoxide;oxolane
CID 11441594
1,6,11,16,21,26,31-heptaoxacyclopentatriacontane
CID 15446455
1,6,11,16,21,26,31,36,41,46-decaoxacyclopentacontane
CID 15446458
oxolane;oxonane
CID 159283889
manganese;oxolane
CID 70504486
1,5,10,14-tetraoxacyclooctadecane
CID 57048709
oxane;oxepane;oxocane;oxolane
CID 159745968
cycloheptane;oxolane
CID 23033083
cyclobutane;oxolane
CID 158733546
oxacyclotetracosane
CID 57108486
oxolane;titanium
CID 160710512
oxacycloheptadecane
CID 22011753

Frequently Asked Questions

What is the IUPAC name of CID 134889513?
The IUPAC name of CID 134889513 (CID 134889513) is not available.
What is the SMILES notation for CID 134889513?
The canonical SMILES for CID 134889513 is C1CCOC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Na].
What is the InChIKey of CID 134889513?
The InChIKey is RCQFFISIVJGACJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.4CO.Co.Na/c1-2-4-5-3-1;4*1-2;;/h1-4H2;;;;;;.
What are the key properties of CID 134889513?
CID 134889513 has a molecular weight of 266.07 g/mol, XLogP of 0.26, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134889513 is sourced from PubChem (CID 134889513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).